Geometry & MOs

Info

ID:	388395
PubChem CID:	134989037
Reduced:	SSeC12H22 (1)
Stoich.:	ABC12D22 (1)
Weight, g/mol:	235.193614
ΔH_f, kcal/mol:	-9.66
Dipole, Da:	3.19
IP(EA), eV:	-8.26(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-adamantyl)-N-ethylpropanamide

Drug info:

PubChemData

Smile

CCCCSC1C(CC([Se]1)C)CC=C

DOS

IR

Vibrations